2-(2-methyl-2,3-dihydroindol-1-yl)-6-(4-methylphenyl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one

Systemtic Name: 2-(2-methyl-2,3-dihydroindol-1-yl)-6-(4-methylphenyl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 2-(2-methylindolin-1-yl)-6-(p-tolyl)-5-thioxo-1H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 2-(2-methyl-2,3-dihydroindol-1-yl)-6-(4-methylphenyl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 2-(2-methyl-2,3-dihydroindol-1-yl)-6-(4-methylphenyl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 2-(2-methylindolin-1-yl)-6-(p-tolyl)-5-thioxo-1H-pyrimido[4,5-d]pyrimidin-4-one Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C3=NC(=O)C4=C(N3)N=CN(C4=S)C5=CC=C(C=C5)C

Isomeric SMILES

CC1CC2=CC=CC=C2N1C3=NC(=O)C4=C(N3)N=CN(C4=S)C5=CC=C(C=C5)C

InChI

InChI=1S/C22H19N5OS/c1-13-7-9-16(10-8-13)26-12-23-19-18(21(26)29)20(28)25-22(24-19)27-14(2)11-15-5-3-4-6-17(15)27/h3-10,12,14H,11H2,1-2H3,(H,24,25,28)